SCHEMBL8988013

SCHEMBL8988013

CCc1nccc(NC(=O)Cc2ccc(Oc3ccc(C(F)(F)F)cc3)cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIOK2 Q9BVS4 2/20 0.48
EPHX2 P34913 2/20 0.47
LTA4H P09960 1/20 0.47
CSNK1D P48730 1/20 0.46
RORC P51449 3/20 0.45
ANO1 Q5XXA6 1/20 0.45
KDR P35968 1/20 0.45
TEK Q02763 1/20 0.45
MAPK10 P53779 2/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GSK3B P49841 1/20 0.43
MAPK14 Q16539 1/20 0.43
ABL1 P00519 2/20 0.42
BCR P11274 2/20 0.42
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
MCHR1 Q99705 1/20 0.42
MAPK8 P45983 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8987685 0.90 EPHX2 (0.47) RIOK2EPHX2LTA4HCSNK1DRORC
SCHEMBL8987904 0.90 CSNK1D (0.47) RIOK2EPHX2LTA4HCSNK1DRORC
SCHEMBL8987866 0.88 ALDH1A1 (0.46) RIOK2EPHX2LTA4HANO1KDR
SCHEMBL8987643 0.87 MAPK10 (0.46) RIOK2CSNK1DANO1MAPK10ALDH1A1
SCHEMBL8987787 0.87 RIOK2 (0.50) RIOK2EPHX2LTA4HCSNK1DRORC
SCHEMBL8987764 0.87 RIOK2 (0.51) RIOK2EPHX2KDRMAPK10ALDH1A1
SCHEMBL8987873 0.86 LMNA (0.49) RIOK2CSNK1DKDRTEKMAPK10
SCHEMBL8987834 0.86 KMT2A (0.51) RIOK2EPHX2LTA4HCSNK1DRORC
SCHEMBL8987654 0.85 RIOK2 (0.51) RIOK2EPHX2LTA4HCSNK1DRORC
SCHEMBL8987854 0.85 RIOK2 (0.48) RIOK2EPHX2LTA4HCSNK1DRORC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5556859-A N-(4-pyrimidinyl)amide pesticides DOWELANCO (US) 1996-09-17 US disclosed